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The time-dependent coupled cluster approach to molecular photodissociation dynamics

✍ Scribed by G. Madhavi Sastry; M. Durga Prasad

Publisher: Elsevier Science
Year: 1994
Tongue: English
Weight: 443 KB
Volume: 228
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(94)00934-1

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✦ Synopsis

The time-dependent coupled cluster method (TDCCM ) has been applied to the photodissociation dynamics of linear triatomits using the Beswick-Jortner model. The autocorrelation function and absorption spectra have been evaluated and the convergence of the method has been tested by evaluating the autocorrelation function at different truncations of the S-matrix elements. It is found that the TDCCM approach converges to exact results quite quickly.

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